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89610-97-9 | 4H-Imidazole-4-thione, 2,2,5-tris(1,1-dimethylethyl)-2,3-dihydro-
CAS No: 89610-97-9 Catalog No: AG003XFF MDL No:
Product Description
Catalog Number:
AG003XFF
Chemical Name:
4H-Imidazole-4-thione, 2,2,5-tris(1,1-dimethylethyl)-2,3-dihydro-
CAS Number:
89610-97-9
Molecular Formula:
C15H28N2S
Molecular Weight:
268.4612
IUPAC Name:
2,2,4-tritert-butyl-1H-imidazole-5-thione
InChI:
InChI=1S/C15H28N2S/c1-12(2,3)10-11(18)17-15(16-10,13(4,5)6)14(7,8)9/h1-9H3,(H,17,18)
InChI Key:
YREFEWSNDQKCII-UHFFFAOYSA-N
SMILES:
S=C1NC(N=C1C(C)(C)C)(C(C)(C)C)C(C)(C)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.197g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
268.463g/mol
Monoisotopic Mass:
268.197g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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